SCHEMBL11768784

SCHEMBL11768784

CCCOc1cc(S(=O)(=O)NC)cc2c(=O)c3cc(C(=O)O)ccc3oc12

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 7/20 0.51
▸ AKR1B1 P15121 1/20 0.47
▸ TTR P02766 5/20 0.44
▸ FABP4 P15090 1/20 0.43
▸ LTB4R2 Q9NPC1 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ PTGER1 P34995 1/20 0.40
▸ PTGER3 P43115 1/20 0.40
▸ PTGER2 P43116 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PTGDR Q13258 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ S1PR3 Q99500 4/20 0.37
▸ S1PR1 P21453 2/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11767487 0.94 LTB4R (0.58) LTB4RAKR1B1TTRLTB4R2ALDH1A1
SCHEMBL11772138 0.92 AKR1B1 (0.49) LTB4RAKR1B1TTRLTB4R2KDM4E
SCHEMBL11771255 0.89 LTB4R (0.53) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11769745 0.89 LTB4R (0.53) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11769275 0.89 LTB4R (0.53) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11770316 0.88 LTB4R (0.52) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11768340 0.88 LTB4R (0.52) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11766177 0.87 LTB4R (0.52) LTB4RAKR1B1TTRFABP4LTB4R2
SCHEMBL11769366 0.87 AKR1B1 (0.52) LTB4RAKR1B1TTRKDM4EMEN1
SCHEMBL11770506 0.86 AKR1B1 (0.64) LTB4RAKR1B1TTRFABP4LTB4R2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3989721-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-11-02 — — US disclosed
US-3989720-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-11-02 — — US disclosed
US-3988352-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-10-26 — — US disclosed
US-3979414-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-09-07 — — US disclosed
US-3965115-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-22 — — US disclosed
US-3963753-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-15 — — US disclosed
US-3963752-A Disubstituted xanthone carboxylic acid compounds SYNTEX (U.S.A.) INC. (US) 1976-06-15 — — US disclosed
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